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0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8532 -3.4760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4209 -1.4423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1139 2.9299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2471 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0398 1.8403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3039 4.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9797 3.5013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6746 2.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9988 3.0296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7314 4.7740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9388 4.6907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9168 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4483 4.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5994 2.6472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2753 1.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2476 0.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5717 1.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 0.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 0.5356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9541 -0.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3813 -2.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2359 -2.6472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.6684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6154 -3.2791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 1.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.7616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 1.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6952 -2.4146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9222 -3.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7691 -3.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.6785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.4516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.3954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0384 -3.3451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9044 -3.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7672 -2.3420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2366 -3.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 -4.0926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4698 -3.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9824 -4.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0565 -1.9439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9225 -1.8067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7853 -0.9407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 20 1 0 0 0 0 2 28 1 0 0 0 0 2 42 1 0 0 0 0 3 29 2 0 0 0 0 4 34 1 0 0 0 0 4 43 1 0 0 0 0 5 40 1 0 0 0 0 5 81 1 0 0 0 0 6 40 2 0 0 0 0 7 19 1 0 0 0 0 7 20 2 0 0 0 0 8 22 1 0 0 0 0 8 24 1 0 0 0 0 8 32 1 0 0 0 0 9 20 1 0 0 0 0 9 29 1 0 0 0 0 9 59 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 10 44 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 14 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 15 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 19 2 0 0 0 0 19 21 1 0 0 0 0 21 28 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 25 1 0 0 0 0 23 26 2 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 60 1 0 0 0 0 26 31 1 0 0 0 0 26 36 1 0 0 0 0 27 33 1 0 0 0 0 27 37 1 0 0 0 0 28 35 1 0 0 0 0 30 34 2 0 0 0 0 30 61 1 0 0 0 0 31 33 2 0 0 0 0 31 39 1 0 0 0 0 32 40 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 64 1 0 0 0 0 34 38 1 0 0 0 0 35 38 2 0 0 0 0 35 65 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 38 41 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 39 74 1 0 0 0 0 41 75 1 0 0 0 0 41 76 1 0 0 0 0 41 77 1 0 0 0 0 42 78 1 0 0 0 0 42 79 1 0 0 0 0 42 80 1 0 0 0 0 43 82 1 0 0 0 0 43 83 1 0 0 0 0 43 84 1 0 0 0 0 M END > 18735247 > 1 > 949 > 7 > 2 > 10 > AAADcfB/OABAAAAAAAAAAAAAAAAAAWLAAAAwYMAAAAAAAFgB/AAAHgQQCAAADQzB3gYz3/PMFgisAyXyfACC+KlnKjkB2DW+bNiOZvLkvbuUMShuwRPY6af4yfCeyQADQAAaAACSAAaAADQAAAAAAAAAAA== > 2-[2-[[5-(2-cyclohexylethyl)-4-(2,5-dimethoxy-4-methyl-phenyl)thiazol-2-yl]carbamoyl]-4,5,7-trimethyl-indol-1-yl]acetic acid > 2-[2-[[[5-(2-cyclohexylethyl)-4-(2,5-dimethoxy-4-methylphenyl)-2-thiazolyl]amino]-oxomethyl]-4,5,7-trimethyl-1-indolyl]acetic acid > 2-[2-[[5-(2-cyclohexylethyl)-4-(2,5-dimethoxy-4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]-4,5,7-trimethylindol-1-yl]acetic acid > 2-[2-[[5-(2-cyclohexylethyl)-4-(2,5-dimethoxy-4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]-4,5,7-trimethylindol-1-yl]acetic acid > 2-[2-[[5-(2-cyclohexylethyl)-4-(2,5-dimethoxy-4-methyl-phenyl)-1,3-thiazol-2-yl]carbamoyl]-4,5,7-trimethyl-indol-1-yl]ethanoic acid > 2-[2-[[5-(2-cyclohexylethyl)-4-(2,5-dimethoxy-4-methyl-phenyl)thiazol-2-yl]carbamoyl]-4,5,7-trimethyl-indol-1-yl]acetic acid > InChI=1S/C34H41N3O5S/c1-19-14-21(3)32-24(22(19)4)16-26(37(32)18-30(38)39)33(40)36-34-35-31(25-17-27(41-5)20(2)15-28(25)42-6)29(43-34)13-12-23-10-8-7-9-11-23/h14-17,23H,7-13,18H2,1-6H3,(H,38,39)(H,35,36,40) > PIJAJKPCTBHVHI-UHFFFAOYSA-N > 8.7 > 603.27669259 > C34H41N3O5S > 603.8 > CC1=CC(=C2C(=C1C)C=C(N2CC(=O)O)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=C(C=C(C(=C5)OC)C)OC)C > CC1=CC(=C2C(=C1C)C=C(N2CC(=O)O)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=C(C=C(C(=C5)OC)C)OC)C > 131 > 603.27669259 > 0 > 43 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 18 8 1 20 8 18 19 8 21 28 8 21 30 8 22 23 8 22 27 8 23 25 8 23 26 8 24 25 8 26 31 8 27 33 8 28 35 8 30 34 8 31 33 8 34 38 8 35 38 8 7 19 8 7 20 8 8 22 8 8 24 8 $$$$